1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylbenzimidazol-1-yl]ethanone

Systemtic Name: 1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylbenzimidazol-1-yl]ethanone Openeye Name: 1-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-[2-[2-oxo-2-(1-piperidyl)ethyl]sulfanylbenzimidazol-1-yl]ethanone CAS Name: 1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-[2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1-benzimidazolyl]ethanone IUPAC Name: 1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-[2-(2-oxo-2-piperidin-1-ylethyl)sulfanylbenzimidazol-1-yl]ethanone Traditional Name: 1-[(3R,5R)-3,5-dimethylpiperidino]-2-[2-[(2-keto-2-piperidino-ethyl)thio]benzimidazol-1-yl]ethanone Formula: C23H32N4O2S MolecularWeight: 428.59078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)N4CCCCC4)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=O)CN2C3=CC=CC=C3N=C2SCC(=O)N4CCCCC4)C

InChI

InChI=1S/C23H32N4O2S/c1-17-12-18(2)14-26(13-17)21(28)15-27-20-9-5-4-8-19(20)24-23(27)30-16-22(29)25-10-6-3-7-11-25/h4-5,8-9,17-18H,3,6-7,10-16H2,1-2H3/t17-,18-/m1/s1